methyl 4-[(1S,3S)-1-oxidanyl-3-[(E)-3-oxidanyloct-1-enyl]cyclohexyl]butanoate

Systemtic Name: methyl 4-[(1S,3S)-1-oxidanyl-3-[(E)-3-oxidanyloct-1-enyl]cyclohexyl]butanoate Openeye Name: methyl 4-[(1S,3S)-1-hydroxy-3-[(E)-3-hydroxyoct-1-enyl]cyclohexyl]butanoate CAS Name: 4-[(1S,3S)-1-hydroxy-3-[(E)-3-hydroxyoct-1-enyl]cyclohexyl]butanoic acid methyl ester IUPAC Name: methyl 4-[(1S,3S)-1-hydroxy-3-[(E)-3-hydroxyoct-1-enyl]cyclohexyl]butanoate Traditional Name: 4-[(1S,3S)-1-hydroxy-3-[(E)-3-hydroxyoct-1-enyl]cyclohexyl]butyric acid methyl ester Formula: C19H34O4 MolecularWeight: 326.47086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCCC(C1)(CCCC(=O)OC)O)O

Isomeric SMILES

CCCCCC(/C=C/[C@H]1CCC[C@@](C1)(CCCC(=O)OC)O)O

InChI

InChI=1S/C19H34O4/c1-3-4-5-9-17(20)12-11-16-8-6-13-19(22,15-16)14-7-10-18(21)23-2/h11-12,16-17,20,22H,3-10,13-15H2,1-2H3/b12-11+/t16-,17?,19+/m1/s1